(4-heptan-2-yloxycarbonylphenyl) 4-decanoyloxy-3-fluoranyl-benzoate

Systemtic Name: (4-heptan-2-yloxycarbonylphenyl) 4-decanoyloxy-3-fluoranyl-benzoate Openeye Name: [4-(1-methylhexoxycarbonyl)phenyl] 4-decanoyloxy-3-fluoro-benzoate CAS Name: 3-fluoro-4-(1-oxodecoxy)benzoic acid [4-[heptan-2-yloxy(oxo)methyl]phenyl] ester IUPAC Name: (4-heptan-2-yloxycarbonylphenyl) 4-decanoyloxy-3-fluorobenzoate Traditional Name: 4-capryloxy-3-fluoro-benzoic acid [4-(1-methylhexoxycarbonyl)phenyl] ester Formula: C31H41FO6 MolecularWeight: 528.652043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC(C)CCCCC)F

Isomeric SMILES

CCCCCCCCCC(=O)OC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC(C)CCCCC)F

InChI

InChI=1S/C31H41FO6/c1-4-6-8-9-10-11-13-15-29(33)38-28-21-18-25(22-27(28)32)31(35)37-26-19-16-24(17-20-26)30(34)36-23(3)14-12-7-5-2/h16-23H,4-15H2,1-3H3